(E)-3-pyrimidin-2-ylsulfanylprop-2-enoic acid

Systemtic Name: (E)-3-pyrimidin-2-ylsulfanylprop-2-enoic acid Openeye Name: (E)-3-pyrimidin-2-ylsulfanylprop-2-enoic acid CAS Name: (E)-3-(2-pyrimidinylthio)-2-propenoic acid IUPAC Name: (E)-3-pyrimidin-2-ylsulfanylprop-2-enoic acid Traditional Name: (E)-3-(2-pyrimidylthio)acrylic acid Formula: C7H6N2O2S MolecularWeight: 182.19974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SC=CC(=O)O

Isomeric SMILES

C1=CN=C(N=C1)S/C=C/C(=O)O

InChI

InChI=1S/C7H6N2O2S/c10-6(11)2-5-12-7-8-3-1-4-9-7/h1-5H,(H,10,11)/b5-2+